#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t8p h LYS 3 N 0.00 0.00 -4.48 4.33 3.64 -1.80 -3.45 116.57 114.81 1t8p h LYS 3 Ca 0.00 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.15 1t8p h LYS 3 Cb 0.00 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 31.64 1t8p h LYS 3 CO 0.00 0.14 -0.71 0.71 -2.27 0.00 0.00 179.45 177.31 1t8p s TYR 4 N -4.19 0.67 -0.02 1.91 1.51 -0.35 -5.01 117.35 111.86 1t8p s TYR 4 Ca -0.03 -0.70 0.01 0.00 -1.01 0.00 0.00 57.07 55.35 1t8p s TYR 4 Cb 0.13 -0.41 0.02 0.00 -0.11 0.00 0.00 41.96 41.59 1t8p s TYR 4 CO 0.60 -0.15 -0.02 0.15 -1.11 0.00 0.00 175.55 175.02 1t8p s LYS 5 N -2.53 0.43 0.03 -0.62 -0.14 -1.26 -0.67 119.74 114.98 1t8p s LYS 5 Ca -0.02 -0.03 0.03 0.00 -1.36 0.00 0.00 55.97 54.59 1t8p s LYS 5 Cb -0.03 -0.51 -0.02 0.00 -1.68 0.00 0.00 37.83 35.59 1t8p s LYS 5 CO -0.03 -0.06 -0.08 -1.17 -0.76 0.00 0.00 175.35 173.25 1t8p s LEU 6 N 0.68 2.16 0.01 3.17 0.20 -0.33 -4.46 118.68 120.11 1t8p s LEU 6 Ca -0.07 -0.39 0.05 0.00 0.69 0.00 0.00 54.13 54.41 1t8p s LEU 6 Cb -0.11 -0.28 -0.03 0.00 -0.43 0.00 0.00 46.19 45.34 1t8p s LEU 6 CO -0.01 -0.07 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.24 1t8p s ILE 7 N -0.87 3.31 0.06 6.68 -1.09 -0.87 -1.05 121.20 127.38 1t8p s ILE 7 Ca -0.04 -0.91 -0.07 0.00 -2.23 0.00 0.00 60.65 57.40 1t8p s ILE 7 Cb -0.07 -2.42 -0.01 0.00 -1.58 0.00 0.00 42.46 38.39 1t8p s ILE 7 CO 0.00 0.39 0.15 -0.32 -1.23 0.00 0.00 174.94 173.93 1t8p s MET 8 N -1.37 0.74 0.15 2.79 -2.45 -0.72 -1.46 119.30 116.97 1t8p s MET 8 Ca 0.16 -0.89 -0.25 0.00 -1.25 0.00 0.00 55.69 53.45 1t8p s MET 8 Cb -0.11 0.30 0.07 0.00 1.25 0.00 0.00 34.83 36.33 1t8p s MET 8 CO 0.06 -0.21 0.99 -0.48 1.05 0.00 0.00 175.02 176.43 1t8p s LEU 9 N -2.59 -0.16 0.03 4.11 -0.00 -0.85 0.43 118.68 119.66 1t8p s LEU 9 Ca 0.02 -0.41 0.06 0.00 -0.00 0.00 0.00 54.13 53.80 1t8p s LEU 9 Cb 0.03 2.11 -0.02 0.00 -0.00 0.00 0.00 46.19 48.31 1t8p s LEU 9 CO -0.08 -0.88 -0.18 0.00 -0.00 0.00 0.00 176.35 175.21 1t8p s ARG 10 N -3.16 1.28 1.15 1.48 1.70 -1.26 -1.14 118.95 119.01 1t8p s ARG 10 Ca 0.13 -0.81 -0.13 0.00 -0.47 0.00 0.00 55.73 54.46 1t8p s ARG 10 Cb -0.01 -1.33 0.28 0.00 -0.57 0.00 0.00 34.95 33.32 1t8p s ARG 10 CO 0.02 0.34 1.04 -3.38 -1.08 0.00 0.00 175.30 172.24 1t8p s HIS 11 N -0.71 1.33 -0.01 5.89 -3.43 -1.18 -1.59 115.29 115.60 1t8p s HIS 11 Ca 0.06 1.25 -0.26 0.00 -0.80 0.00 0.00 55.06 55.30 1t8p s HIS 11 Cb -0.08 -3.12 -0.04 0.00 -1.43 0.00 0.00 32.58 27.91 1t8p s HIS 11 CO 0.01 -3.84 0.82 0.20 -2.00 0.00 0.00 174.74 169.93 1t8p s GLY 12 N -2.49 2.77 0.96 -1.38 0.00 -1.26 -4.44 107.32 101.48 1t8p s GLY 12 Ca 0.68 0.32 -0.11 0.00 0.00 0.00 0.00 44.72 45.62 1t8p s GLY 12 CO 0.64 1.34 1.12 -0.54 0.00 0.00 0.00 173.10 175.67 1t8p s GLU 13 N 0.64 0.65 0.00 2.90 0.41 -1.26 -4.66 118.70 117.38 1t8p s GLU 13 Ca 0.43 1.40 0.00 0.00 -0.41 0.00 0.00 54.97 56.39 1t8p s GLU 13 Cb -0.20 -1.70 0.00 0.00 -1.78 0.00 0.00 34.13 30.46 1t8p s GLU 13 CO 0.23 -2.83 0.00 0.41 -0.49 0.00 0.00 175.26 172.58 1t8p n GLY 14 N 0.29 3.68 0.23 -1.39 0.00 -1.26 -4.73 105.19 102.01 1t8p n GLY 14 Ca 0.10 -1.77 -0.08 0.00 0.00 0.00 0.00 46.02 44.27 1t8p n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8p h ALA 15 N 0.11 0.67 -0.64 4.61 0.00 -1.96 -3.06 119.26 118.98 1t8p h ALA 15 Ca 0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1t8p h ALA 15 Cb 0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1t8p h ALA 15 CO 0.00 0.24 0.33 -1.49 0.00 0.00 0.00 179.25 178.33 1t8p h TRP 16 N 0.69 0.91 -0.96 0.00 4.06 -1.96 -2.61 115.95 116.07 1t8p h TRP 16 Ca 0.18 -0.03 0.05 0.00 2.06 0.00 0.00 58.89 61.15 1t8p h TRP 16 Cb 0.13 -0.29 -0.06 0.00 -1.00 0.00 0.00 29.16 27.95 1t8p h TRP 16 CO -0.00 0.66 0.62 -0.97 -3.56 0.00 0.00 178.44 175.19 1t8p h ASN 17 N 0.88 1.01 -0.70 -3.49 -1.24 -1.55 0.24 115.58 110.72 1t8p h ASN 17 Ca 0.22 0.00 0.04 0.00 0.71 0.00 0.00 56.30 57.28 1t8p h ASN 17 Cb 0.08 -0.21 -0.05 0.00 0.73 0.00 0.00 38.32 38.87 1t8p h ASN 17 CO -0.03 0.66 0.43 0.11 -1.29 0.00 0.00 177.43 177.31 1t8p h LYS 18 N 1.16 0.80 -0.27 6.67 1.57 -1.38 0.70 116.57 125.81 1t8p h LYS 18 Ca 0.40 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1t8p h LYS 18 Cb 0.11 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1t8p h LYS 18 CO -0.15 0.53 0.00 0.39 -0.57 0.00 0.00 179.45 179.64 1t8p n GLU 19 N -4.69 1.22 -3.57 3.15 1.02 -0.80 -4.86 120.64 112.11 1t8p n GLU 19 Ca 0.08 -0.28 -0.24 0.00 -0.02 0.00 0.00 57.16 56.70 1t8p n GLU 19 Cb 0.12 -1.17 0.07 0.00 -0.02 0.00 0.00 31.44 30.44 1t8p n GLU 19 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1t8p n ASN 20 N -0.21 -6.28 -4.60 1.62 3.02 0.24 -4.79 115.26 104.26 1t8p n ASN 20 Ca 0.03 -0.53 -0.28 0.00 -0.03 0.00 0.00 54.58 53.77 1t8p n ASN 20 Cb 0.12 -4.96 -0.09 0.00 -0.61 0.00 0.00 39.78 34.25 1t8p n ASN 20 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1t8p s ARG 21 N -6.28 2.17 -0.35 3.52 0.52 0.76 -3.95 118.95 115.34 1t8p s ARG 21 Ca 0.57 -1.14 -0.11 0.00 -0.52 0.00 0.00 55.73 54.53 1t8p s ARG 21 Cb -0.25 -2.26 0.01 0.00 0.52 0.00 0.00 34.95 32.96 1t8p s ARG 21 CO 0.70 0.47 0.20 -0.06 0.02 0.00 0.00 175.30 176.64 1t8p s PHE 22 N -1.53 3.22 0.22 -0.53 0.08 -1.26 -3.38 117.98 114.79 1t8p s PHE 22 Ca 0.24 -0.64 -0.09 0.00 0.12 0.00 0.00 56.93 56.57 1t8p s PHE 22 Cb -0.10 -2.43 0.19 0.00 -0.57 0.00 0.00 43.02 40.10 1t8p s PHE 22 CO 0.16 -0.52 1.88 0.00 -0.10 0.00 0.00 175.22 176.64 1t8p n SER 24 N -4.47 0.00 -0.27 0.00 2.88 -1.26 -1.24 113.62 109.26 1t8p n SER 24 Ca 0.09 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.75 1t8p n SER 24 Cb 0.04 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 64.10 1t8p n SER 24 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1t8p n TRP 25 N 14.00 0.05 -2.13 0.66 7.02 -1.26 -4.73 117.44 131.05 1t8p n TRP 25 Ca 0.00 -0.03 -0.42 0.00 -1.02 0.00 0.00 57.50 56.03 1t8p n TRP 25 Cb 0.00 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.86 1t8p n TRP 25 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1t8p s VAL 26 N -1.95 3.29 -1.51 -0.99 1.01 -0.37 -4.88 120.40 114.99 1t8p s VAL 26 Ca 0.37 0.87 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 1t8p s VAL 26 Cb 0.19 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 1t8p s VAL 26 CO 0.30 0.05 2.57 -0.67 0.00 0.00 0.00 175.10 177.35 1t8p n ASP 27 N 4.39 6.70 -4.78 3.32 2.03 -1.26 -4.95 116.55 121.99 1t8p n ASP 27 Ca 0.12 -2.76 -0.37 0.00 0.52 0.00 0.00 54.79 52.30 1t8p n ASP 27 Cb 0.42 -1.57 -0.06 0.00 -0.72 0.00 0.00 41.12 39.19 1t8p n ASP 27 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1t8p s GLN 28 N 2.08 4.56 0.47 -0.67 -0.21 -1.26 -4.84 119.66 119.79 1t8p s GLN 28 Ca 0.58 1.38 -0.11 0.00 0.02 0.00 0.00 55.36 57.23 1t8p s GLN 28 Cb 0.16 -2.82 -0.06 0.00 1.00 0.00 0.00 33.01 31.29 1t8p s GLN 28 CO -0.07 0.24 0.86 0.15 -2.12 0.00 0.00 175.29 174.35 1t8p s LYS 29 N -2.02 3.77 0.45 2.91 1.02 -1.26 -4.15 119.74 120.45 1t8p s LYS 29 Ca 0.50 0.59 -0.24 0.00 0.02 0.00 0.00 55.97 56.84 1t8p s LYS 29 Cb -0.20 -2.29 -0.08 0.00 -0.52 0.00 0.00 37.83 34.75 1t8p s LYS 29 CO 0.25 -0.18 1.30 -0.51 -0.92 0.00 0.00 175.35 175.29 1t8p s LEU 30 N -4.18 4.09 0.00 3.17 1.43 -1.26 -5.00 118.68 116.93 1t8p s LEU 30 Ca 0.53 2.64 -0.02 0.00 -1.03 0.00 0.00 54.13 56.25 1t8p s LEU 30 Cb -0.10 -4.05 0.08 0.00 0.03 0.00 0.00 46.19 42.15 1t8p s LEU 30 CO 0.36 -1.05 0.52 -0.46 0.23 0.00 0.00 176.35 175.95 1t8p n ASN 31 N -0.27 0.50 -0.05 2.29 0.23 -1.26 -4.83 115.26 111.88 1t8p n ASN 31 Ca 0.06 -1.47 -0.08 0.00 -0.53 0.00 0.00 54.58 52.56 1t8p n ASN 31 Cb 0.44 -0.36 -0.02 0.00 -2.08 0.00 0.00 39.78 37.77 1t8p n ASN 31 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1t8p h SER 32 N -0.43 -0.26 -0.32 0.53 0.02 -1.99 -1.73 113.55 109.37 1t8p h SER 32 Ca -0.17 0.07 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1t8p h SER 32 Cb 0.58 0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 1t8p h SER 32 CO 0.16 -0.10 0.16 -0.08 -1.14 0.00 0.00 176.83 175.84 1t8p h GLU 33 N -0.03 0.32 -0.29 3.45 4.81 -1.96 -2.18 114.58 118.70 1t8p h GLU 33 Ca 0.11 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 1t8p h GLU 33 Cb 0.20 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1t8p h GLU 33 CO -0.24 0.21 0.10 0.78 -0.73 0.00 0.00 179.01 179.13 1t8p h GLY 34 N 0.33 0.43 2.00 1.92 0.00 -1.77 -1.79 103.07 104.19 1t8p h GLY 34 Ca 0.13 -0.20 -0.12 0.00 0.00 0.00 0.00 47.33 47.14 1t8p h GLY 34 CO -0.09 0.19 -0.57 -0.33 0.00 0.00 0.00 176.54 175.74 1t8p h MET 35 N 0.41 0.00 -0.22 4.80 2.86 -0.91 -2.91 114.93 118.96 1t8p h MET 35 Ca 0.10 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.56 1t8p h MET 35 Cb 0.12 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 1t8p h MET 35 CO -0.01 0.57 -0.60 0.93 1.06 0.00 0.00 176.91 178.86 1t8p h GLU 36 N 0.00 0.71 -0.41 1.72 5.08 -0.74 -2.73 114.58 118.22 1t8p h GLU 36 Ca -0.01 -0.48 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 1t8p h GLU 36 Cb 1.08 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 1t8p h GLU 36 CO 0.07 1.10 0.22 0.93 -1.00 0.00 0.00 179.01 180.34 1t8p h GLU 37 N 0.53 0.57 -0.67 2.33 5.08 -1.28 0.07 114.58 121.22 1t8p h GLU 37 Ca -0.00 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1t8p h GLU 37 Cb 1.18 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 1t8p h GLU 37 CO 0.12 0.47 0.44 0.00 -1.00 0.00 0.00 179.01 179.04 1t8p h ALA 38 N 1.08 0.85 0.53 3.43 0.00 -1.49 0.88 119.26 124.53 1t8p h ALA 38 Ca 0.14 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1t8p h ALA 38 Cb 0.06 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.58 1t8p h ALA 38 CO -0.02 0.28 -0.25 0.00 0.00 0.00 0.00 179.25 179.26 1t8p h ARG 39 N 0.91 -0.68 -0.80 0.00 3.08 -1.21 -1.31 114.38 114.38 1t8p h ARG 39 Ca 0.25 0.05 0.16 0.00 0.07 0.00 0.00 59.98 60.50 1t8p h ARG 39 Cb -0.10 0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.05 1t8p h ARG 39 CO -0.05 -0.38 0.53 -0.91 -1.07 0.00 0.00 179.97 178.09 1t8p h ASN 40 N -0.95 0.44 -0.49 7.04 2.35 -0.86 0.27 115.58 123.37 1t8p h ASN 40 Ca -0.07 0.03 -0.12 0.00 -0.55 0.00 0.00 56.30 55.59 1t8p h ASN 40 Cb 0.62 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 1t8p h ASN 40 CO 0.12 0.22 -0.13 0.00 -1.65 0.00 0.00 177.43 175.98 1t8p h GLY 42 N 0.93 1.05 1.31 0.00 0.00 0.62 -1.56 103.07 105.43 1t8p h GLY 42 Ca 0.13 -0.84 -0.07 0.00 0.00 0.00 0.00 47.33 46.55 1t8p h GLY 42 CO 0.05 0.77 0.04 0.50 0.00 0.00 0.00 176.54 177.90 1t8p h LYS 43 N 0.86 0.84 -0.64 4.80 1.57 -0.67 0.10 116.57 123.44 1t8p h LYS 43 Ca 0.13 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 1t8p h LYS 43 Cb 0.67 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1t8p h LYS 43 CO 0.05 0.82 0.06 0.37 -0.57 0.00 0.00 179.45 180.18 1t8p h GLN 44 N 0.79 1.09 -0.22 3.15 5.75 -0.75 -0.08 115.11 124.84 1t8p h GLN 44 Ca 0.16 -0.32 -0.19 0.00 -0.15 0.00 0.00 58.65 58.15 1t8p h GLN 44 Cb 0.42 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 28.86 1t8p h GLN 44 CO 0.02 1.03 -0.62 -0.07 -2.65 0.00 0.00 178.83 176.53 1t8p h LEU 45 N 1.00 0.93 -0.83 -2.39 3.38 -0.89 -2.51 115.31 114.00 1t8p h LEU 45 Ca 0.19 -0.58 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 1t8p h LEU 45 Cb 0.49 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1t8p h LEU 45 CO 0.02 1.34 0.34 0.50 0.09 0.00 0.00 178.44 180.73 1t8p h LYS 46 N 0.56 1.20 0.00 1.13 3.64 -0.66 -0.85 116.57 121.59 1t8p h LYS 46 Ca -0.02 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.15 1t8p h LYS 46 Cb 1.24 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1t8p h LYS 46 CO 0.13 0.95 -0.03 0.00 -2.27 0.00 0.00 179.45 178.24 1t8p h ALA 47 N 1.20 1.11 -0.63 5.00 0.00 -0.89 0.28 119.26 125.33 1t8p h ALA 47 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1t8p h ALA 47 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1t8p h ALA 47 CO -0.03 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.54 1t8p n LEU 48 N -3.28 3.87 -4.00 0.00 4.77 -0.42 -4.97 117.00 112.97 1t8p n LEU 48 Ca -0.02 -2.10 -0.31 0.00 -0.03 0.00 0.00 56.01 53.55 1t8p n LEU 48 Cb 0.17 -0.45 0.01 0.00 -2.33 0.00 0.00 43.42 40.82 1t8p n LEU 48 CO 0.25 0.90 0.05 0.59 -1.33 0.00 0.00 177.39 177.84 1t8p n ASN 49 N 1.27 -4.00 -4.72 -1.43 3.02 0.09 -4.93 115.26 104.55 1t8p n ASN 49 Ca 0.22 -0.86 -0.42 0.00 -0.03 0.00 0.00 54.58 53.49 1t8p n ASN 49 Cb 0.63 -3.52 -0.03 0.00 -0.61 0.00 0.00 39.78 36.25 1t8p n ASN 49 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1t8p s PHE 50 N -3.34 3.48 -0.30 3.10 0.40 -0.71 -5.01 117.98 115.61 1t8p s PHE 50 Ca 0.63 1.41 0.03 0.00 -0.60 0.00 0.00 56.93 58.40 1t8p s PHE 50 Cb -0.32 -3.37 0.08 0.00 0.51 0.00 0.00 43.02 39.91 1t8p s PHE 50 CO 0.86 -1.05 -0.04 -1.21 0.70 0.00 0.00 175.22 174.49 1t8p s GLU 51 N 0.50 1.97 0.24 0.44 2.02 -1.26 -4.83 118.70 117.79 1t8p s GLU 51 Ca 0.55 -1.55 -0.10 0.00 0.02 0.00 0.00 54.97 53.89 1t8p s GLU 51 Cb -0.30 -3.04 -0.07 0.00 0.10 0.00 0.00 34.13 30.82 1t8p s GLU 51 CO 0.32 -0.72 0.57 -0.06 0.02 0.00 0.00 175.26 175.38 1t8p s PHE 52 N 1.04 3.42 -0.06 1.61 0.40 -1.26 -4.66 117.98 118.47 1t8p s PHE 52 Ca -0.01 0.90 0.10 0.00 -0.60 0.00 0.00 56.93 57.32 1t8p s PHE 52 Cb -0.20 -2.28 -0.16 0.00 0.51 0.00 0.00 43.02 40.90 1t8p s PHE 52 CO -0.06 0.25 0.25 -0.25 0.70 0.00 0.00 175.22 176.11 1t8p n ASP 53 N -0.20 2.39 -3.57 1.36 10.43 0.28 -4.91 116.55 122.33 1t8p n ASP 53 Ca 0.01 -0.08 -0.16 0.00 2.57 0.00 0.00 54.79 57.12 1t8p n ASP 53 Cb 0.53 1.42 -0.06 0.00 1.84 0.00 0.00 41.12 44.84 1t8p n ASP 53 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 1t8p s LEU 54 N -3.58 -0.32 -0.02 0.64 2.96 -1.18 -4.24 118.68 112.94 1t8p s LEU 54 Ca -0.03 0.51 0.03 0.00 -0.22 0.00 0.00 54.13 54.42 1t8p s LEU 54 Cb 0.07 2.27 -0.01 0.00 0.50 0.00 0.00 46.19 49.02 1t8p s LEU 54 CO 0.43 -0.61 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.05 1t8p s VAL 55 N -1.48 0.91 -0.08 1.68 1.01 -0.09 -2.49 120.40 119.87 1t8p s VAL 55 Ca -0.10 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1t8p s VAL 55 Cb -0.01 -0.77 -0.00 0.00 0.00 0.00 0.00 36.38 35.60 1t8p s VAL 55 CO 0.07 0.26 -0.22 -0.36 0.00 0.00 0.00 175.10 174.85 1t8p s PHE 56 N -0.13 2.28 0.31 5.22 0.40 -0.32 -0.26 117.98 125.47 1t8p s PHE 56 Ca 0.02 -0.82 0.06 0.00 -0.60 0.00 0.00 56.93 55.59 1t8p s PHE 56 Cb -0.06 -1.53 -0.02 0.00 0.51 0.00 0.00 43.02 41.92 1t8p s PHE 56 CO -0.00 -0.31 0.22 0.25 0.70 0.00 0.00 175.22 176.07 1t8p n THR 57 N 3.35 0.00 -2.83 0.64 -2.24 0.18 -1.24 114.28 112.14 1t8p n THR 57 Ca -0.19 -2.13 -0.04 0.00 -2.27 0.00 0.00 64.05 59.42 1t8p n THR 57 Cb 0.53 0.99 0.02 0.00 -2.10 0.00 0.00 70.33 69.76 1t8p n THR 57 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1t8p n SER 58 N -1.78 0.41 -0.11 3.42 3.41 -1.25 -1.44 113.62 116.28 1t8p n SER 58 Ca 0.04 -1.31 0.12 0.00 -0.26 0.00 0.00 58.87 57.46 1t8p n SER 58 Cb 0.53 -0.10 0.18 0.00 -0.26 0.00 0.00 64.21 64.56 1t8p n SER 58 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1t8p n VAL 59 N -1.39 0.00 -2.77 -3.33 0.31 -1.17 -4.17 118.33 105.82 1t8p n VAL 59 Ca 0.04 -0.06 -0.42 0.00 -0.01 0.00 0.00 64.34 63.89 1t8p n VAL 59 Cb 0.13 0.54 -0.03 0.00 -0.91 0.00 0.00 33.84 33.57 1t8p n VAL 59 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1t8p s LEU 60 N -2.83 4.32 0.61 7.52 1.43 -1.26 -4.95 118.68 123.53 1t8p s LEU 60 Ca 0.14 1.53 0.34 0.00 -1.03 0.00 0.00 54.13 55.12 1t8p s LEU 60 Cb 0.18 -3.47 2.00 0.00 0.03 0.00 0.00 46.19 44.92 1t8p s LEU 60 CO 0.68 -0.29 2.28 -0.55 0.23 0.00 0.00 176.35 178.70 1t8p h ASN 61 N 6.90 0.00 0.32 2.29 -1.07 -1.88 -1.85 115.58 120.29 1t8p h ASN 61 Ca -0.38 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 55.91 1t8p h ASN 61 Cb 1.19 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.43 1t8p h ASN 61 CO 0.78 0.01 -0.36 0.08 0.07 0.00 0.00 177.43 178.01 1t8p h ARG 62 N 0.00 0.05 -0.05 4.14 0.11 -1.93 0.76 114.38 117.47 1t8p h ARG 62 Ca -0.00 -0.02 -0.02 0.00 0.10 0.00 0.00 59.98 60.04 1t8p h ARG 62 Cb 0.02 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.10 1t8p h ARG 62 CO 0.00 0.41 -0.06 1.03 0.10 0.00 0.00 179.97 181.45 1t8p h SER 63 N 0.05 0.14 0.14 0.08 0.87 -1.68 -2.89 113.55 110.26 1t8p h SER 63 Ca 0.00 -0.50 -0.01 0.00 -1.23 0.00 0.00 61.79 60.05 1t8p h SER 63 Cb 0.66 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 1t8p h SER 63 CO 0.05 0.62 -0.07 0.40 -0.53 0.00 0.00 176.83 177.30 1t8p h ILE 64 N -0.32 0.97 -0.57 2.23 2.04 -1.43 -2.68 117.51 117.74 1t8p h ILE 64 Ca 0.01 -0.44 0.08 0.00 1.00 0.00 0.00 64.86 65.50 1t8p h ILE 64 Cb 0.58 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1t8p h ILE 64 CO 0.01 0.11 0.38 0.45 0.00 0.00 0.00 178.15 179.10 1t8p h HIS 65 N -0.39 0.48 -0.51 1.37 3.86 -0.96 0.51 115.15 119.51 1t8p h HIS 65 Ca -0.02 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.17 1t8p h HIS 65 Cb 0.31 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 1t8p h HIS 65 CO -0.00 0.24 0.17 1.15 0.86 0.00 0.00 177.93 180.35 1t8p h THR 66 N 0.46 1.23 -0.59 2.45 2.02 -1.38 -1.77 112.91 115.33 1t8p h THR 66 Ca 0.25 -0.74 -0.04 0.00 0.77 0.00 0.00 66.41 66.65 1t8p h THR 66 Cb 0.40 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1t8p h THR 66 CO -0.07 0.27 0.20 0.00 0.37 0.00 0.00 175.52 176.30 1t8p h ALA 67 N 1.03 0.77 -0.50 6.16 0.00 -0.64 -2.35 119.26 123.73 1t8p h ALA 67 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1t8p h ALA 67 Cb 0.25 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1t8p h ALA 67 CO -0.01 0.42 0.30 -1.49 0.00 0.00 0.00 179.25 178.48 1t8p h TRP 68 N 0.83 0.65 -0.30 0.00 6.55 -0.80 -0.72 115.95 122.17 1t8p h TRP 68 Ca 0.19 -0.00 -0.05 0.00 0.95 0.00 0.00 58.89 59.98 1t8p h TRP 68 Cb 0.26 -0.21 -0.02 0.00 -0.86 0.00 0.00 29.16 28.33 1t8p h TRP 68 CO 0.02 0.45 -0.04 -0.07 -1.05 0.00 0.00 178.44 177.75 1t8p h LEU 69 N 0.66 0.44 -0.18 -4.49 3.38 -1.21 -0.07 115.31 113.85 1t8p h LEU 69 Ca 0.18 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.88 1t8p h LEU 69 Cb -0.01 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 40.63 1t8p h LEU 69 CO -0.03 0.54 -0.60 0.40 0.09 0.00 0.00 178.44 178.83 1t8p h ILE 70 N 0.45 1.30 -0.68 1.22 2.04 -0.98 -2.28 117.51 118.58 1t8p h ILE 70 Ca 0.09 -1.83 -0.06 0.00 1.00 0.00 0.00 64.86 64.07 1t8p h ILE 70 Cb 0.36 1.92 -0.03 0.00 -0.74 0.00 0.00 36.82 38.33 1t8p h ILE 70 CO 0.01 0.58 0.19 -0.07 0.00 0.00 0.00 178.15 178.86 1t8p h LEU 71 N 0.45 1.00 -0.56 1.44 3.38 -0.78 -0.76 115.31 119.48 1t8p h LEU 71 Ca -0.02 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1t8p h LEU 71 Cb 1.23 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1t8p h LEU 71 CO 0.13 0.95 0.18 -0.08 0.09 0.00 0.00 178.44 179.71 1t8p h GLU 72 N 1.02 0.87 0.00 1.13 4.81 -0.99 0.39 114.58 121.81 1t8p h GLU 72 Ca 0.22 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1t8p h GLU 72 Cb 0.32 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1t8p h GLU 72 CO -0.00 0.79 -0.25 0.93 -0.73 0.00 0.00 179.01 179.75 1t8p h GLU 73 N 0.79 0.00 0.00 1.92 4.39 -0.99 -1.93 114.58 118.75 1t8p h GLU 73 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1t8p h GLU 73 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1t8p h GLU 73 CO -0.01 0.25 -0.57 1.28 -1.16 0.00 0.00 179.01 178.80 1t8p n LEU 74 N -4.22 0.57 -1.20 1.33 4.77 -0.33 -4.82 117.00 113.11 1t8p n LEU 74 Ca -0.02 0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 55.97 1t8p n LEU 74 Cb 0.30 -0.22 -0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1t8p n LEU 74 CO 0.37 0.03 -0.14 0.61 -1.33 0.00 0.00 177.39 176.94 1t8p n GLY 75 N 1.42 0.13 1.74 -0.72 0.00 0.11 -4.92 105.19 102.94 1t8p n GLY 75 Ca 0.04 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 1t8p n GLY 75 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1t8p n GLN 76 N -2.17 3.22 0.22 1.61 6.02 0.49 -4.79 117.38 121.98 1t8p n GLN 76 Ca -0.13 -4.00 0.14 0.00 -0.01 0.00 0.00 57.00 53.00 1t8p n GLN 76 Cb 0.56 -2.15 0.73 0.00 1.02 0.00 0.00 30.24 30.40 1t8p n GLN 76 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1t8p h GLU 77 N 1.95 0.00 0.00 -1.09 3.07 -1.91 -0.95 114.58 115.64 1t8p h GLU 77 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1t8p h GLU 77 Cb 1.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.34 1t8p h GLU 77 CO 0.61 0.00 -0.08 0.11 -1.40 0.00 0.00 179.01 178.25 1t8p h TRP 78 N 0.00 0.00 -2.44 4.33 5.08 -1.93 -3.46 115.95 117.53 1t8p h TRP 78 Ca 0.00 0.00 -0.55 0.00 1.08 0.00 0.00 58.89 59.42 1t8p h TRP 78 Cb 0.13 0.00 0.05 0.00 -3.00 0.00 0.00 29.16 26.34 1t8p h TRP 78 CO 0.00 0.00 0.98 0.28 -1.28 0.00 0.00 178.44 178.42 1t8p n VAL 79 N -2.66 0.15 -1.68 0.12 0.31 -0.36 -4.88 118.33 109.32 1t8p n VAL 79 Ca 0.04 -0.03 -0.44 0.00 -0.01 0.00 0.00 64.34 63.91 1t8p n VAL 79 Cb 0.48 -1.88 -0.02 0.00 -0.91 0.00 0.00 33.84 31.51 1t8p n VAL 79 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1t8p n PRO 80 N 4.49 2.08 -5.08 5.55 -0.02 -1.26 -4.79 135.00 135.97 1t8p n PRO 80 Ca 0.17 0.74 -0.32 0.00 -2.02 0.00 0.00 63.50 62.07 1t8p n PRO 80 Cb 0.33 -2.39 -0.15 0.00 -0.02 0.00 0.00 33.50 31.27 1t8p n PRO 80 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1t8p s VAL 81 N -0.19 2.50 -0.06 -1.45 1.01 -1.26 -0.91 120.40 120.03 1t8p s VAL 81 Ca 0.66 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.75 1t8p s VAL 81 Cb -0.63 -1.96 0.02 0.00 0.00 0.00 0.00 36.38 33.81 1t8p s VAL 81 CO 0.51 0.57 -0.08 -0.70 0.00 0.00 0.00 175.10 175.40 1t8p s GLU 82 N -0.22 1.26 0.03 2.72 2.12 0.64 -4.97 118.70 120.27 1t8p s GLU 82 Ca -0.01 -0.24 0.05 0.00 0.36 0.00 0.00 54.97 55.13 1t8p s GLU 82 Cb -0.13 -1.15 -0.03 0.00 0.26 0.00 0.00 34.13 33.07 1t8p s GLU 82 CO 0.03 -0.06 -0.11 -1.12 -0.54 0.00 0.00 175.26 173.46 1t8p s SER 83 N 0.92 4.32 -0.09 -1.70 0.01 -1.26 -0.65 113.70 115.26 1t8p s SER 83 Ca -0.11 -0.27 -0.15 0.00 1.31 0.00 0.00 55.95 56.74 1t8p s SER 83 Cb -0.15 -0.90 0.03 0.00 0.21 0.00 0.00 66.02 65.22 1t8p s SER 83 CO 0.01 0.26 0.37 -0.55 0.41 0.00 0.00 173.24 173.74 1t8p s SER 84 N -1.52 -0.33 0.50 2.44 0.15 -0.52 -4.91 113.70 109.51 1t8p s SER 84 Ca 0.17 0.49 0.28 0.00 0.70 0.00 0.00 55.95 57.59 1t8p s SER 84 Cb -0.11 0.58 1.23 0.00 -1.71 0.00 0.00 66.02 66.01 1t8p s SER 84 CO 0.08 -0.29 1.95 4.11 1.20 0.00 0.00 173.24 180.29 1t8p h TRP 85 N 4.72 0.00 0.00 3.44 5.08 -1.89 -2.49 115.95 124.81 1t8p h TRP 85 Ca -0.28 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.69 1t8p h TRP 85 Cb 1.18 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.34 1t8p h TRP 85 CO 0.45 0.14 0.00 0.54 -1.28 0.00 0.00 178.44 178.29 1t8p n ARG 86 N -3.37 0.30 -0.01 0.12 1.74 -1.26 -0.03 116.66 114.14 1t8p n ARG 86 Ca -0.00 0.06 0.04 0.00 -0.77 0.00 0.00 57.85 57.17 1t8p n ARG 86 Cb 0.34 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.31 1t8p n ARG 86 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1t8p n LEU 87 N -1.10 1.69 -4.69 0.55 7.94 -0.95 -4.21 117.00 116.24 1t8p n LEU 87 Ca 0.08 -1.11 -0.33 0.00 -1.11 0.00 0.00 56.01 53.55 1t8p n LEU 87 Cb 0.06 -0.02 0.14 0.00 0.53 0.00 0.00 43.42 44.14 1t8p n LEU 87 CO 0.07 0.36 0.74 0.20 -1.11 0.00 0.00 177.39 177.65 1t8p s ASN 88 N -0.63 3.29 1.04 1.96 -0.87 0.95 -4.43 114.94 116.25 1t8p s ASN 88 Ca 0.09 2.32 -0.12 0.00 -1.57 0.00 0.00 52.86 53.57 1t8p s ASN 88 Cb 0.06 -2.58 0.22 0.00 -0.02 0.00 0.00 41.25 38.92 1t8p s ASN 88 CO 0.09 -2.87 1.07 -0.70 -2.57 0.00 0.00 177.10 172.12 1t8p s GLU 89 N -4.32 0.04 0.31 -0.60 2.56 -1.26 -4.42 118.70 110.99 1t8p s GLU 89 Ca 0.71 0.86 -0.29 0.00 0.00 0.00 0.00 54.97 56.25 1t8p s GLU 89 Cb -0.27 -1.66 -0.11 0.00 2.00 0.00 0.00 34.13 34.09 1t8p s GLU 89 CO 0.53 -3.09 1.47 0.50 -0.56 0.00 0.00 175.26 174.11 1t8p s ARG 90 N -4.68 4.21 -0.38 4.30 3.52 -1.26 -4.80 118.95 119.86 1t8p s ARG 90 Ca 0.67 2.42 -0.24 0.00 -0.13 0.00 0.00 55.73 58.45 1t8p s ARG 90 Cb -0.22 -3.05 0.01 0.00 -1.56 0.00 0.00 34.95 30.14 1t8p s ARG 90 CO 0.61 -0.46 0.85 -1.58 -0.81 0.00 0.00 175.30 173.90 1t8p s HIS 91 N -0.49 3.08 -1.79 5.12 5.65 -1.26 -4.45 115.29 121.15 1t8p s HIS 91 Ca 0.57 0.60 0.06 0.00 0.25 0.00 0.00 55.06 56.53 1t8p s HIS 91 Cb -0.44 -3.55 0.19 0.00 -1.18 0.00 0.00 32.58 27.60 1t8p s HIS 91 CO 0.51 -0.81 1.10 0.66 -0.65 0.00 0.00 174.74 175.55 1t8p n TYR 92 N 6.62 0.33 0.00 3.88 4.01 -1.26 0.48 117.16 131.22 1t8p n TYR 92 Ca 0.05 -0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 1t8p n TYR 92 Cb 0.48 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 1t8p n TYR 92 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1t8p n GLY 93 N 0.71 3.66 0.00 2.72 0.00 -1.25 -1.88 105.19 109.15 1t8p n GLY 93 Ca 0.07 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1t8p n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t8p n ALA 94 N 12.10 2.15 1.75 4.61 0.00 -0.80 -3.09 120.51 137.22 1t8p n ALA 94 Ca 0.00 -0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.51 1t8p n ALA 94 Cb 0.00 -1.41 0.82 0.00 0.00 0.00 0.00 19.45 18.87 1t8p n ALA 94 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1t8p n LEU 95 N -1.51 0.21 -4.68 0.00 4.77 -0.79 -4.84 117.00 110.17 1t8p n LEU 95 Ca 0.06 0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.63 1t8p n LEU 95 Cb 0.29 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1t8p n LEU 95 CO 0.23 0.04 1.38 -0.63 -1.33 0.00 0.00 177.39 177.08 1t8p s ILE 96 N -2.18 3.19 0.00 -0.08 1.01 -1.18 -3.15 121.20 118.80 1t8p s ILE 96 Ca 0.40 0.48 0.00 0.00 0.00 0.00 0.00 60.65 61.53 1t8p s ILE 96 Cb 0.21 -3.31 0.00 0.00 0.01 0.00 0.00 42.46 39.38 1t8p s ILE 96 CO 0.40 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1t8p n GLY 97 N 4.12 3.11 3.76 6.18 0.00 -1.18 -4.96 105.19 116.22 1t8p n GLY 97 Ca 0.17 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 1t8p n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t8p s LEU 98 N 0.00 2.96 0.00 0.99 1.43 -1.19 -4.70 118.68 118.18 1t8p s LEU 98 Ca 0.00 1.81 0.01 0.00 -1.03 0.00 0.00 54.13 54.92 1t8p s LEU 98 Cb 0.00 -4.47 0.02 0.00 0.03 0.00 0.00 46.19 41.76 1t8p s LEU 98 CO 0.00 -2.12 0.14 -0.46 0.23 0.00 0.00 176.35 174.14 1t8p n ASN 99 N -3.58 0.32 -0.14 2.29 0.23 -1.26 -4.12 115.26 109.00 1t8p n ASN 99 Ca 0.09 -1.24 -0.10 0.00 -0.53 0.00 0.00 54.58 52.81 1t8p n ASN 99 Cb 0.53 -0.08 -0.01 0.00 -2.08 0.00 0.00 39.78 38.14 1t8p n ASN 99 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 1t8p h ARG 100 N 0.00 0.65 -0.50 -3.83 2.43 -1.87 -2.92 114.38 108.34 1t8p h ARG 100 Ca -0.05 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 58.93 1t8p h ARG 100 Cb 0.21 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1t8p h ARG 100 CO 0.06 0.67 0.17 0.93 -1.51 0.00 0.00 179.97 180.29 1t8p h GLU 101 N 0.51 0.76 -0.54 0.20 3.07 -1.95 -2.52 114.58 114.12 1t8p h GLU 101 Ca 0.13 -0.16 -0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1t8p h GLU 101 Cb 0.31 -0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.08 1t8p h GLU 101 CO 0.00 0.70 0.32 1.96 -1.40 0.00 0.00 179.01 180.59 1t8p h GLN 102 N 0.67 0.72 -0.06 2.33 4.20 -1.94 -1.95 115.11 119.08 1t8p h GLN 102 Ca 0.16 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1t8p h GLN 102 Cb 0.25 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1t8p h GLN 102 CO -0.01 0.51 -0.01 0.52 -0.67 0.00 0.00 178.83 179.17 1t8p h MET 103 N 0.73 0.12 -0.95 1.46 2.86 -1.30 -2.61 114.93 115.24 1t8p h MET 103 Ca 0.19 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1t8p h MET 103 Cb -0.03 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 1t8p h MET 103 CO -0.04 0.44 0.58 0.00 1.06 0.00 0.00 176.91 178.96 1t8p h ALA 104 N 0.67 1.21 -0.15 6.32 0.00 -1.28 -1.05 119.26 124.98 1t8p h ALA 104 Ca 0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1t8p h ALA 104 Cb 0.40 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1t8p h ALA 104 CO 0.01 0.65 0.09 -0.07 0.00 0.00 0.00 179.25 179.92 1t8p h LEU 105 N 1.30 0.18 0.00 0.00 3.38 -1.32 0.85 115.31 119.70 1t8p h LEU 105 Ca 0.34 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1t8p h LEU 105 Cb -0.08 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1t8p h LEU 105 CO -0.07 0.17 -0.35 0.59 0.09 0.00 0.00 178.44 178.88 1t8p n ASN 106 N -4.96 0.55 0.00 -0.43 3.02 -0.99 -4.54 115.26 107.92 1t8p n ASN 106 Ca -0.04 0.20 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 1t8p n ASN 106 Cb 0.05 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1t8p n ASN 106 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1t8p n HIS 107 N -1.89 0.00 0.00 3.10 8.25 -0.41 -5.10 115.22 119.17 1t8p n HIS 107 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1t8p n HIS 107 Cb 0.40 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.51 1t8p n HIS 107 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1t8p n GLY 108 N 1.84 3.36 0.21 -1.41 0.00 0.29 -4.63 105.19 104.84 1t8p n GLY 108 Ca 0.00 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 1t8p n GLY 108 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1t8p h GLU 109 N 0.00 -0.22 -0.81 1.61 4.22 -1.89 0.23 114.58 117.73 1t8p h GLU 109 Ca 0.00 0.01 0.12 0.00 0.08 0.00 0.00 59.36 59.57 1t8p h GLU 109 Cb 0.00 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.22 1t8p h GLU 109 CO 0.00 -0.14 0.43 0.93 -2.18 0.00 0.00 179.01 178.05 1t8p h GLU 110 N -0.22 0.66 -0.30 1.92 4.39 -1.94 -1.57 114.58 117.52 1t8p h GLU 110 Ca 0.09 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.61 1t8p h GLU 110 Cb 0.35 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1t8p h GLU 110 CO -0.23 0.44 -0.37 0.37 -1.16 0.00 0.00 179.01 178.06 1t8p h GLN 111 N 0.68 0.68 -0.07 2.33 5.75 -1.52 -3.16 115.11 119.80 1t8p h GLN 111 Ca 0.41 -0.34 -0.11 0.00 -0.15 0.00 0.00 58.65 58.47 1t8p h GLN 111 Cb 0.49 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 1t8p h GLN 111 CO -0.30 0.94 -0.45 0.28 -2.65 0.00 0.00 178.83 176.65 1t8p h VAL 112 N 0.57 1.33 -0.06 2.39 2.07 0.32 -3.28 116.25 119.59 1t8p h VAL 112 Ca 0.05 -1.61 0.04 0.00 0.82 0.00 0.00 66.70 66.01 1t8p h VAL 112 Cb 0.89 1.78 -0.06 0.00 -1.52 0.00 0.00 31.29 32.38 1t8p h VAL 112 CO 0.08 0.47 -0.38 0.03 0.02 0.00 0.00 177.57 177.79 1t8p h ARG 113 N 0.13 -0.48 -0.07 1.57 3.08 -1.28 -2.88 114.38 114.45 1t8p h ARG 113 Ca 0.01 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.13 1t8p h ARG 113 Cb 0.86 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.96 1t8p h ARG 113 CO 0.07 -0.32 -0.27 -0.07 -1.07 0.00 0.00 179.97 178.30 1t8p h LEU 114 N -0.50 -0.84 -1.90 3.04 3.38 -1.70 -1.79 115.31 115.00 1t8p h LEU 114 Ca 0.07 0.12 0.27 0.00 0.09 0.00 0.00 57.88 58.43 1t8p h LEU 114 Cb 0.61 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 41.67 1t8p h LEU 114 CO -0.33 -0.33 0.76 -0.50 0.09 0.00 0.00 178.44 178.12 1t8p h TRP 115 N -0.38 0.00 0.00 1.13 6.55 -1.60 0.34 115.95 121.99 1t8p h TRP 115 Ca 0.08 0.00 -0.06 0.00 0.95 0.00 0.00 58.89 59.86 1t8p h TRP 115 Cb 0.50 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.79 1t8p h TRP 115 CO -0.34 0.00 -1.60 0.54 -1.05 0.00 0.00 178.44 175.99 1t8p n ARG 116 N -3.98 0.96 0.00 0.49 3.00 -1.13 -4.68 116.66 111.31 1t8p n ARG 116 Ca 0.20 -0.07 0.06 0.00 -0.01 0.00 0.00 57.85 58.02 1t8p n ARG 116 Cb 1.08 -1.28 0.04 0.00 0.00 0.00 0.00 32.46 32.30 1t8p n ARG 116 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 1t8p n ARG 117 N -2.07 1.01 -3.64 5.56 -4.01 -0.69 -5.02 116.66 107.80 1t8p n ARG 117 Ca -0.07 -1.06 -0.20 0.00 -1.04 0.00 0.00 57.85 55.47 1t8p n ARG 117 Cb 0.48 -1.20 -0.03 0.00 -3.04 0.00 0.00 32.46 28.68 1t8p n ARG 117 CO 0.00 0.00 0.00 -1.54 -3.04 0.00 0.00 177.63 173.05 1t8p s SER 118 N -1.12 5.38 -0.00 2.89 1.04 0.11 -4.98 113.70 117.02 1t8p s SER 118 Ca 0.13 -0.49 0.21 0.00 0.48 0.00 0.00 55.95 56.28 1t8p s SER 118 Cb 0.10 -0.91 -0.25 0.00 0.10 0.00 0.00 66.02 65.05 1t8p s SER 118 CO 0.18 -0.46 0.55 0.00 0.98 0.00 0.00 173.24 174.50 1t8p n TYR 119 N -1.49 0.25 -0.32 5.02 9.36 -1.26 -4.66 117.16 124.06 1t8p n TYR 119 Ca 0.00 0.07 0.00 0.00 3.32 0.00 0.00 57.90 61.30 1t8p n TYR 119 Cb 0.60 -0.69 0.00 0.00 -0.63 0.00 0.00 39.34 38.62 1t8p n TYR 119 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1t8p n ASN 120 N -2.44 0.90 -4.58 2.98 0.23 -1.26 -1.35 115.26 109.73 1t8p n ASN 120 Ca -0.07 -1.22 -0.42 0.00 -0.53 0.00 0.00 54.58 52.34 1t8p n ASN 120 Cb 0.66 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.30 1t8p n ASN 120 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1t8p s VAL 121 N -0.22 4.89 -0.04 3.53 1.01 -1.26 -4.91 120.40 123.40 1t8p s VAL 121 Ca 0.00 0.72 -0.27 0.00 0.00 0.00 0.00 61.98 62.43 1t8p s VAL 121 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1t8p s VAL 121 CO 0.00 -0.25 0.85 -0.89 0.00 0.00 0.00 175.10 174.81 1t8p s THR 122 N 2.70 4.95 0.95 3.92 2.01 -1.26 -4.56 115.64 124.35 1t8p s THR 122 Ca 0.25 1.77 -0.12 0.00 0.31 0.00 0.00 61.69 63.90 1t8p s THR 122 Cb -0.15 -4.19 0.16 0.00 0.01 0.00 0.00 72.50 68.34 1t8p s THR 122 CO 0.14 0.19 1.09 -2.84 -0.69 0.00 0.00 174.62 172.51 1t8p s PRO 123 N 0.99 0.79 0.64 4.92 0.02 -1.26 -4.95 135.00 136.15 1t8p s PRO 123 Ca 0.45 0.92 -0.18 0.00 0.02 0.00 0.00 61.00 62.21 1t8p s PRO 123 Cb -0.19 -1.75 -0.01 0.00 0.02 0.00 0.00 34.50 32.57 1t8p s PRO 123 CO 0.23 -2.59 1.24 -1.25 -0.33 0.00 0.00 177.00 174.29 1t8p s PRO 124 N -4.81 2.67 0.57 5.54 0.04 -1.26 -4.67 135.00 133.07 1t8p s PRO 124 Ca 0.65 1.89 -0.20 0.00 0.04 0.00 0.00 61.00 63.38 1t8p s PRO 124 Cb -0.20 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1t8p s PRO 124 CO 0.59 -1.46 1.26 -2.14 0.04 0.00 0.00 177.00 175.29 1t8p s PRO 125 N -3.47 3.08 0.30 0.56 0.02 -1.26 -1.91 135.00 132.32 1t8p s PRO 125 Ca 0.78 1.98 -0.28 0.00 0.02 0.00 0.00 61.00 63.51 1t8p s PRO 125 Cb -0.32 -2.09 -0.09 0.00 0.02 0.00 0.00 34.50 32.01 1t8p s PRO 125 CO 0.38 -1.16 0.99 -1.50 -0.33 0.00 0.00 177.00 175.38 1t8p s ILE 126 N -1.46 3.95 0.28 2.83 2.07 0.72 -3.89 121.20 125.69 1t8p s ILE 126 Ca 0.74 1.77 0.10 0.00 -1.41 0.00 0.00 60.65 61.86 1t8p s ILE 126 Cb -0.34 -4.05 -0.05 0.00 0.13 0.00 0.00 42.46 38.14 1t8p s ILE 126 CO 0.39 0.28 -0.15 -1.61 -1.91 0.00 0.00 174.94 171.94 1t8p s GLU 127 N -1.72 1.64 0.42 3.50 2.02 -1.26 -4.91 118.70 118.39 1t8p s GLU 127 Ca 0.47 -1.78 0.26 0.00 0.02 0.00 0.00 54.97 53.95 1t8p s GLU 127 Cb -0.24 -1.57 1.36 0.00 0.10 0.00 0.00 34.13 33.78 1t8p s GLU 127 CO 0.30 0.22 1.63 0.93 0.02 0.00 0.00 175.26 178.37 1t8p h GLU 128 N 2.26 0.11 0.00 1.61 4.39 -1.97 0.83 114.58 121.82 1t8p h GLU 128 Ca -0.40 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.29 1t8p h GLU 128 Cb 1.25 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1t8p h GLU 128 CO 0.64 0.08 0.00 -1.13 -1.16 0.00 0.00 179.01 177.43 1t8p n SER 129 N -4.80 0.00 -4.75 1.42 3.41 -1.26 -4.78 113.62 102.86 1t8p n SER 129 Ca 0.36 0.46 -0.41 0.00 -0.26 0.00 0.00 58.87 59.02 1t8p n SER 129 Cb 1.33 -0.48 -0.04 0.00 -0.26 0.00 0.00 64.21 64.77 1t8p n SER 129 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1t8p s HIS 130 N -2.97 3.44 0.48 7.33 5.04 0.29 -4.92 115.29 123.98 1t8p s HIS 130 Ca 0.12 1.54 0.26 0.00 -1.54 0.00 0.00 55.06 55.43 1t8p s HIS 130 Cb 0.15 -3.40 1.31 0.00 0.04 0.00 0.00 32.58 30.67 1t8p s HIS 130 CO 0.40 -1.02 1.84 -1.35 -2.34 0.00 0.00 174.74 172.27 1t8p h PRO 131 N 4.42 0.18 -0.35 2.88 0.11 -1.88 -1.99 132.00 135.38 1t8p h PRO 131 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1t8p h PRO 131 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1t8p h PRO 131 CO 0.70 0.12 0.00 0.66 -0.21 0.00 0.00 178.00 179.27 1t8p n TYR 132 N -4.40 0.45 0.13 0.65 4.02 -1.26 -4.64 117.16 112.12 1t8p n TYR 132 Ca 0.21 -0.32 -0.13 0.00 -0.01 0.00 0.00 57.90 57.66 1t8p n TYR 132 Cb 0.92 -0.01 -0.06 0.00 -0.02 0.00 0.00 39.34 40.17 1t8p n TYR 132 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 176.86 174.93 1t8p h TYR 133 N 3.21 -0.53 0.10 -0.72 3.20 -1.62 -2.94 116.97 117.67 1t8p h TYR 133 Ca 0.00 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1t8p h TYR 133 Cb 0.80 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.28 1t8p h TYR 133 CO 0.23 -0.30 -0.06 1.96 -1.64 0.00 0.00 178.16 178.35 1t8p h GLN 134 N -0.42 -0.15 -0.90 1.82 1.08 -1.82 -2.54 115.11 112.17 1t8p h GLN 134 Ca 0.01 0.01 0.22 0.00 -1.45 0.00 0.00 58.65 57.44 1t8p h GLN 134 Cb 0.41 0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.81 1t8p h GLN 134 CO -0.07 -0.10 0.61 1.49 -0.95 0.00 0.00 178.83 179.80 1t8p h GLU 135 N -0.16 0.28 0.00 1.46 4.81 -1.84 0.47 114.58 119.60 1t8p h GLU 135 Ca -0.01 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1t8p h GLU 135 Cb 0.13 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.45 1t8p h GLU 135 CO 0.01 0.19 -0.03 0.82 -0.73 0.00 0.00 179.01 179.26 1t8p h ILE 136 N 0.29 0.06 0.00 2.32 2.04 -1.33 -3.35 117.51 117.54 1t8p h ILE 136 Ca 0.46 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.28 1t8p h ILE 136 Cb 1.33 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 1t8p h ILE 136 CO -0.14 0.02 0.00 1.88 0.00 0.00 0.00 178.15 179.91 1t8p h TYR 137 N -1.00 0.00 0.00 1.37 -1.99 -1.32 -2.95 116.97 111.08 1t8p h TYR 137 Ca -0.00 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.66 1t8p h TYR 137 Cb 0.07 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.78 1t8p h TYR 137 CO -0.00 0.00 -0.52 -0.91 -0.00 0.00 0.00 178.16 176.73 1t8p h ASN 138 N 0.00 0.00 -2.35 3.88 -0.26 -1.10 -3.46 115.58 112.30 1t8p h ASN 138 Ca 0.00 0.00 -0.54 0.00 -0.56 0.00 0.00 56.30 55.20 1t8p h ASN 138 Cb 0.49 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.77 1t8p h ASN 138 CO 0.00 0.32 1.19 -0.67 -1.06 0.00 0.00 177.43 177.21 1t8p n ASP 139 N -3.10 4.05 0.00 5.81 -0.08 -1.11 -4.85 116.55 117.27 1t8p n ASP 139 Ca 0.01 0.93 0.05 0.00 -1.51 0.00 0.00 54.79 54.27 1t8p n ASP 139 Cb 0.67 -1.51 0.29 0.00 2.34 0.00 0.00 41.12 42.91 1t8p n ASP 139 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1t8p n ARG 140 N 6.96 0.29 0.16 -0.67 1.85 -1.26 -1.86 116.66 122.13 1t8p n ARG 140 Ca 0.20 0.02 0.04 0.00 -1.00 0.00 0.00 57.85 57.11 1t8p n ARG 140 Cb 0.39 -1.50 0.14 0.00 -1.05 0.00 0.00 32.46 30.44 1t8p n ARG 140 CO 0.00 0.00 0.00 0.07 -0.01 0.00 0.00 177.63 177.69 1t8p h ARG 141 N 0.00 0.00 -0.18 2.89 0.11 -1.94 -2.91 114.38 112.35 1t8p h ARG 141 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1t8p h ARG 141 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 1t8p h ARG 141 CO 0.00 0.44 0.00 0.66 0.10 0.00 0.00 179.97 181.17 1t8p n TYR 142 N -3.30 0.24 -0.08 4.08 4.01 -0.78 -3.48 117.16 117.86 1t8p n TYR 142 Ca 0.01 -0.12 0.09 0.00 -0.16 0.00 0.00 57.90 57.73 1t8p n TYR 142 Cb 0.65 0.00 0.22 0.00 -0.31 0.00 0.00 39.34 39.90 1t8p n TYR 142 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1t8p n LYS 143 N 0.16 2.55 -2.49 -0.72 5.02 -1.10 -4.12 118.16 117.46 1t8p n LYS 143 Ca 0.13 -2.26 -0.01 0.00 -2.02 0.00 0.00 58.31 54.15 1t8p n LYS 143 Cb 0.25 -1.43 0.05 0.00 -0.02 0.00 0.00 35.03 33.88 1t8p n LYS 143 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1t8p n VAL 144 N 1.17 1.14 -2.83 -0.18 0.24 -1.23 -4.96 118.33 111.69 1t8p n VAL 144 Ca 0.18 -2.66 -0.21 0.00 -2.04 0.00 0.00 64.34 59.61 1t8p n VAL 144 Cb 0.53 1.05 0.07 0.00 -1.47 0.00 0.00 33.84 34.02 1t8p n VAL 144 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1t8p n ASP 146 N -2.43 0.00 -3.78 0.00 5.68 -1.26 -4.66 116.55 110.10 1t8p n ASP 146 Ca 0.14 -0.99 -0.13 0.00 -0.50 0.00 0.00 54.79 53.31 1t8p n ASP 146 Cb 0.61 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.47 1t8p n ASP 146 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 1t8p s VAL 147 N -2.00 -0.01 0.70 2.12 -7.23 -1.26 -5.15 120.40 107.57 1t8p s VAL 147 Ca 0.25 0.02 -0.16 0.00 -1.81 0.00 0.00 61.98 60.28 1t8p s VAL 147 Cb 0.12 -0.35 -0.04 0.00 0.56 0.00 0.00 36.38 36.66 1t8p s VAL 147 CO 0.19 0.01 0.56 -0.81 -0.31 0.00 0.00 175.10 174.74 1t8p n PRO 148 N 3.15 0.35 -0.22 4.82 -0.04 -1.26 -4.79 135.00 137.01 1t8p n PRO 148 Ca -0.15 0.16 0.02 0.00 -0.04 0.00 0.00 63.50 63.49 1t8p n PRO 148 Cb 0.57 -1.84 0.10 0.00 -0.04 0.00 0.00 33.50 32.30 1t8p n PRO 148 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1t8p h LEU 149 N -0.26 -0.43 -2.17 1.53 5.85 -1.94 0.69 115.31 118.58 1t8p h LEU 149 Ca -0.46 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1t8p h LEU 149 Cb 1.36 0.34 0.00 0.00 0.37 0.00 0.00 40.66 42.73 1t8p h LEU 149 CO 0.44 -0.17 0.00 -2.24 -0.34 0.00 0.00 178.44 176.12 1t8p h ASP 150 N 0.06 0.00 0.08 1.25 3.04 -1.93 -2.26 116.42 116.66 1t8p h ASP 150 Ca 0.34 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.13 1t8p h ASP 150 Cb 0.56 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.85 1t8p h ASP 150 CO -0.62 0.00 -0.08 1.67 -2.04 0.00 0.00 179.24 178.17 1t8p n GLN 151 N -3.06 1.35 -1.88 4.15 7.27 0.23 -4.93 117.38 120.51 1t8p n GLN 151 Ca -0.01 -0.75 -0.30 0.00 0.07 0.00 0.00 57.00 56.02 1t8p n GLN 151 Cb 0.19 -1.48 0.06 0.00 2.41 0.00 0.00 30.24 31.42 1t8p n GLN 151 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1t8p s LEU 152 N -2.17 2.77 0.41 1.69 1.43 -0.85 -4.95 118.68 117.01 1t8p s LEU 152 Ca 0.34 1.03 -0.25 0.00 -1.03 0.00 0.00 54.13 54.22 1t8p s LEU 152 Cb 0.20 -3.73 -0.08 0.00 0.03 0.00 0.00 46.19 42.62 1t8p s LEU 152 CO 0.40 -1.54 1.26 -2.84 0.23 0.00 0.00 176.35 173.86 1t8p s PRO 153 N -5.42 3.94 0.00 1.29 0.02 -1.26 -4.93 135.00 128.63 1t8p s PRO 153 Ca 0.59 2.05 0.04 0.00 0.02 0.00 0.00 61.00 63.71 1t8p s PRO 153 Cb -0.11 -2.69 -0.00 0.00 0.02 0.00 0.00 34.50 31.72 1t8p s PRO 153 CO 0.51 -0.48 0.41 0.54 -0.33 0.00 0.00 177.00 177.65 1t8p n ARG 154 N 0.02 2.56 -3.64 5.54 5.12 -1.26 -5.03 116.66 119.97 1t8p n ARG 154 Ca 0.04 -0.39 -0.02 0.00 -1.93 0.00 0.00 57.85 55.55 1t8p n ARG 154 Cb 0.45 -0.89 -0.02 0.00 -1.16 0.00 0.00 32.46 30.83 1t8p n ARG 154 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1t8p s SER 155 N -0.85 -0.02 0.02 0.55 1.04 -1.26 -0.20 113.70 112.98 1t8p s SER 155 Ca 0.03 0.00 -0.24 0.00 0.48 0.00 0.00 55.95 56.23 1t8p s SER 155 Cb 0.03 0.02 0.05 0.00 0.10 0.00 0.00 66.02 66.23 1t8p s SER 155 CO 0.11 -0.03 0.54 -1.61 0.98 0.00 0.00 173.24 173.22 1t8p s GLU 156 N -1.98 1.02 0.39 4.02 2.02 0.18 -4.88 118.70 119.47 1t8p s GLU 156 Ca 0.11 -0.13 0.08 0.00 0.02 0.00 0.00 54.97 55.05 1t8p s GLU 156 Cb -0.01 0.47 -0.02 0.00 0.10 0.00 0.00 34.13 34.67 1t8p s GLU 156 CO -0.03 -0.35 0.38 -1.54 0.02 0.00 0.00 175.26 173.73 1t8p s SER 157 N -1.77 5.20 0.45 -0.19 1.04 -1.26 -4.37 113.70 112.80 1t8p s SER 157 Ca -0.07 -0.63 0.13 0.00 0.48 0.00 0.00 55.95 55.86 1t8p s SER 157 Cb -0.01 -0.71 1.01 0.00 0.10 0.00 0.00 66.02 66.41 1t8p s SER 157 CO 0.01 -0.57 2.02 0.25 0.98 0.00 0.00 173.24 175.93 1t8p h LEU 158 N 1.05 0.09 -0.38 2.42 5.85 -1.82 -1.15 115.31 121.37 1t8p h LEU 158 Ca -0.42 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.23 1t8p h LEU 158 Cb 1.26 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1t8p h LEU 158 CO 0.56 0.19 0.00 0.50 -0.34 0.00 0.00 178.44 179.36 1t8p h LYS 159 N 0.10 0.67 -0.24 1.25 3.64 -1.58 -1.56 116.57 118.85 1t8p h LYS 159 Ca 0.02 -0.21 0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1t8p h LYS 159 Cb 0.21 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 1t8p h LYS 159 CO 0.01 0.76 0.06 -0.44 -2.27 0.00 0.00 179.45 177.58 1t8p h ASP 160 N 0.49 0.04 -0.35 4.20 3.32 -1.53 -1.37 116.42 121.21 1t8p h ASP 160 Ca 0.11 0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.26 1t8p h ASP 160 Cb 0.46 0.04 -0.07 0.00 0.22 0.00 0.00 39.33 39.97 1t8p h ASP 160 CO 0.02 0.06 -0.13 0.58 -1.72 0.00 0.00 179.24 178.04 1t8p h VAL 161 N 0.16 0.56 -0.86 -1.35 2.07 -1.00 -1.19 116.25 114.63 1t8p h VAL 161 Ca 0.11 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.66 1t8p h VAL 161 Cb 0.09 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 1t8p h VAL 161 CO -0.13 0.00 0.57 0.25 0.02 0.00 0.00 177.57 178.28 1t8p h LEU 162 N -0.06 0.92 -1.30 2.57 5.85 -0.83 -1.23 115.31 121.24 1t8p h LEU 162 Ca 0.18 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1t8p h LEU 162 Cb 0.33 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1t8p h LEU 162 CO -0.40 0.63 -0.34 -0.33 -0.34 0.00 0.00 178.44 177.66 1t8p h GLU 163 N 1.07 0.01 0.00 1.25 5.08 -0.12 0.35 114.58 122.22 1t8p h GLU 163 Ca 0.35 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 1t8p h GLU 163 Cb 0.04 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1t8p h GLU 163 CO -0.10 0.36 -0.94 2.89 -1.00 0.00 0.00 179.01 180.21 1t8p n ARG 164 N -4.13 0.07 -0.01 2.33 -4.01 -0.82 -4.24 116.66 105.85 1t8p n ARG 164 Ca -0.02 -0.01 -0.21 0.00 -1.04 0.00 0.00 57.85 56.57 1t8p n ARG 164 Cb 0.38 -1.51 -0.13 0.00 -3.04 0.00 0.00 32.46 28.16 1t8p n ARG 164 CO 0.00 0.00 0.00 1.25 -3.04 0.00 0.00 177.63 175.84 1t8p h LEU 165 N 0.00 0.31 -0.82 2.89 5.85 -1.01 -3.39 115.31 119.13 1t8p h LEU 165 Ca 0.00 -0.83 0.13 0.00 0.84 0.00 0.00 57.88 58.03 1t8p h LEU 165 Cb 0.56 -0.10 -0.14 0.00 0.37 0.00 0.00 40.66 41.35 1t8p h LEU 165 CO 0.00 1.54 -0.36 -0.07 -0.34 0.00 0.00 178.44 179.21 1t8p h LEU 166 N -0.45 -1.31 -1.05 2.25 3.38 -1.10 0.62 115.31 117.66 1t8p h LEU 166 Ca -0.28 0.27 0.24 0.00 0.09 0.00 0.00 57.88 58.21 1t8p h LEU 166 Cb 1.64 0.68 -0.12 0.00 0.09 0.00 0.00 40.66 42.94 1t8p h LEU 166 CO 0.02 -0.30 0.61 -0.65 0.09 0.00 0.00 178.44 178.22 1t8p h PRO 167 N -0.07 0.56 -0.08 1.13 0.11 -1.77 0.67 132.00 132.55 1t8p h PRO 167 Ca 0.30 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 66.18 1t8p h PRO 167 Cb 0.58 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 1t8p h PRO 167 CO -0.85 0.37 -0.76 -0.92 -0.21 0.00 0.00 178.00 175.62 1t8p h TYR 168 N 0.57 0.64 0.32 0.65 3.20 -1.11 -0.98 116.97 120.26 1t8p h TYR 168 Ca 0.63 -0.29 -0.02 0.00 3.14 0.00 0.00 58.73 62.20 1t8p h TYR 168 Cb 1.24 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1t8p h TYR 168 CO -0.01 1.07 -0.15 2.35 -1.64 0.00 0.00 178.16 179.78 1t8p h TRP 169 N 0.31 -0.39 -0.72 -3.82 2.91 -0.36 -1.12 115.95 112.77 1t8p h TRP 169 Ca -0.04 -0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.97 1t8p h TRP 169 Cb 1.35 0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 30.10 1t8p h TRP 169 CO 0.05 -0.06 0.45 -0.91 -1.03 0.00 0.00 178.44 176.95 1t8p h ASN 170 N -0.78 0.84 0.44 2.65 2.35 -1.00 0.30 115.58 120.37 1t8p h ASN 170 Ca -0.04 -0.04 -0.31 0.00 -0.55 0.00 0.00 56.30 55.36 1t8p h ASN 170 Cb 0.51 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1t8p h ASN 170 CO 0.07 0.63 -1.62 -0.33 -1.65 0.00 0.00 177.43 174.53 1t8p h GLU 171 N 0.97 0.17 0.00 0.81 5.08 -1.26 -3.40 114.58 116.95 1t8p h GLU 171 Ca 0.26 -0.30 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 1t8p h GLU 171 Cb -0.07 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1t8p h GLU 171 CO -0.05 0.97 -1.65 -2.13 -1.00 0.00 0.00 179.01 175.15 1t8p n ARG 172 N -3.35 0.26 -0.07 2.33 3.00 -0.47 -4.75 116.66 113.61 1t8p n ARG 172 Ca -0.18 0.09 -0.11 0.00 -0.00 0.00 0.00 57.85 57.65 1t8p n ARG 172 Cb 1.04 -1.07 -0.09 0.00 0.00 0.00 0.00 32.46 32.34 1t8p n ARG 172 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1t8p h ILE 173 N -0.22 1.24 -0.61 5.15 2.04 -1.07 -3.37 117.51 120.67 1t8p h ILE 173 Ca -0.28 -1.97 0.12 0.00 1.00 0.00 0.00 64.86 63.73 1t8p h ILE 173 Cb 1.32 2.39 -0.09 0.00 -0.74 0.00 0.00 36.82 39.70 1t8p h ILE 173 CO -0.11 0.42 0.13 0.00 0.00 0.00 0.00 178.15 178.59 1t8p h ALA 174 N -0.31 0.73 -0.79 1.87 0.00 -0.66 -1.24 119.26 118.85 1t8p h ALA 174 Ca -0.03 0.13 0.19 0.00 0.00 0.00 0.00 54.91 55.20 1t8p h ALA 174 Cb 0.77 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1t8p h ALA 174 CO -0.02 -0.31 0.54 -1.35 0.00 0.00 0.00 179.25 178.12 1t8p h PRO 175 N 0.26 0.25 -0.08 0.00 0.11 -1.78 -0.54 132.00 130.22 1t8p h PRO 175 Ca 0.32 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 66.24 1t8p h PRO 175 Cb 0.48 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1t8p h PRO 175 CO -0.41 0.17 -0.70 0.93 -0.21 0.00 0.00 178.00 177.77 1t8p h GLU 176 N 0.26 0.39 -0.04 1.05 4.39 -1.39 -2.53 114.58 116.70 1t8p h GLU 176 Ca 0.39 -0.31 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1t8p h GLU 176 Cb 1.16 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1t8p h GLU 176 CO -0.10 0.94 -0.01 0.28 -1.16 0.00 0.00 179.01 178.97 1t8p h VAL 177 N 0.27 1.28 0.00 3.13 2.07 -0.91 -2.44 116.25 119.65 1t8p h VAL 177 Ca -0.02 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1t8p h VAL 177 Cb 1.27 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 1t8p h VAL 177 CO 0.12 0.23 0.00 0.18 0.02 0.00 0.00 177.57 178.12 1t8p n LEU 178 N -4.87 0.42 -0.92 2.57 4.77 -0.61 -0.68 117.00 117.69 1t8p n LEU 178 Ca -0.07 0.68 0.11 0.00 -0.03 0.00 0.00 56.01 56.70 1t8p n LEU 178 Cb 0.20 -0.71 0.27 0.00 -2.33 0.00 0.00 43.42 40.85 1t8p n LEU 178 CO 0.34 -0.78 0.73 -1.14 -1.33 0.00 0.00 177.39 175.21 1t8p n ARG 179 N -2.04 2.20 -0.53 3.23 0.63 -0.96 -4.94 116.66 114.24 1t8p n ARG 179 Ca -0.01 -1.82 0.00 0.00 -0.92 0.00 0.00 57.85 55.11 1t8p n ARG 179 Cb 0.05 -1.46 0.00 0.00 0.45 0.00 0.00 32.46 31.50 1t8p n ARG 179 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1t8p n GLY 180 N 1.35 0.76 3.80 5.14 0.00 0.15 -5.06 105.19 111.33 1t8p n GLY 180 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1t8p n GLY 180 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1t8p s LYS 181 N -0.47 4.39 -0.37 1.61 1.02 -0.95 -5.03 119.74 119.94 1t8p s LYS 181 Ca 0.00 1.14 -0.18 0.00 0.02 0.00 0.00 55.97 56.95 1t8p s LYS 181 Cb 0.00 -2.65 0.00 0.00 -0.52 0.00 0.00 37.83 34.66 1t8p s LYS 181 CO 0.00 0.23 0.50 0.99 -0.92 0.00 0.00 175.35 176.15 1t8p s THR 182 N -1.75 5.02 0.11 2.17 2.01 -1.26 -4.55 115.64 117.38 1t8p s THR 182 Ca 0.52 0.19 0.04 0.00 0.31 0.00 0.00 61.69 62.74 1t8p s THR 182 Cb -0.15 -3.99 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 1t8p s THR 182 CO 0.20 -0.28 0.10 -0.63 -0.69 0.00 0.00 174.62 173.32 1t8p s ILE 183 N 2.37 4.52 -0.06 1.82 -1.09 -1.26 -0.56 121.20 126.95 1t8p s ILE 183 Ca 0.18 -0.86 0.04 0.00 -2.23 0.00 0.00 60.65 57.77 1t8p s ILE 183 Cb -0.16 -3.22 0.00 0.00 -1.58 0.00 0.00 42.46 37.51 1t8p s ILE 183 CO 0.14 0.05 -0.17 -0.22 -1.23 0.00 0.00 174.94 173.51 1t8p s LEU 184 N -2.61 1.89 -0.25 2.97 2.96 -1.04 -2.04 118.68 120.56 1t8p s LEU 184 Ca 0.30 -0.38 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 1t8p s LEU 184 Cb -0.12 -1.03 0.06 0.00 0.50 0.00 0.00 46.19 45.61 1t8p s LEU 184 CO 0.22 0.13 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.65 1t8p s ILE 185 N 0.22 2.10 -0.55 6.68 1.01 -0.53 -1.18 121.20 128.95 1t8p s ILE 185 Ca -0.09 -1.56 -0.20 0.00 0.00 0.00 0.00 60.65 58.80 1t8p s ILE 185 Cb -0.14 -2.21 0.07 0.00 0.01 0.00 0.00 42.46 40.19 1t8p s ILE 185 CO 0.04 -0.01 0.72 -0.55 0.00 0.00 0.00 174.94 175.14 1t8p s SER 186 N 1.14 6.23 0.00 3.58 0.15 -0.37 -2.01 113.70 122.42 1t8p s SER 186 Ca -0.08 -0.95 0.00 0.00 0.70 0.00 0.00 55.95 55.62 1t8p s SER 186 Cb -0.20 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 1t8p s SER 186 CO -0.06 -1.04 0.00 0.00 1.20 0.00 0.00 173.24 173.34 1t8p n ALA 187 N 6.54 0.00 -4.26 5.45 0.00 -0.29 -3.89 120.51 124.06 1t8p n ALA 187 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.24 1t8p n ALA 187 Cb 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 1t8p n ALA 187 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1t8p n HIS 188 N 0.00 0.44 0.24 0.00 8.25 -1.26 -3.11 115.22 119.79 1t8p n HIS 188 Ca 0.00 -1.16 -0.16 0.00 -0.26 0.00 0.00 57.72 56.13 1t8p n HIS 188 Cb 0.00 -0.12 -0.09 0.00 1.12 0.00 0.00 29.99 30.90 1t8p n HIS 188 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1t8p h GLY 189 N 0.60 -1.21 1.61 -1.41 0.00 -1.96 -1.51 103.07 99.19 1t8p h GLY 189 Ca -0.18 0.58 -0.20 0.00 0.00 0.00 0.00 47.33 47.53 1t8p h GLY 189 CO 0.30 -0.35 -0.81 3.43 0.00 0.00 0.00 176.54 179.11 1t8p h ASN 190 N -0.89 0.46 0.06 0.19 2.35 -1.95 -2.06 115.58 113.74 1t8p h ASN 190 Ca -0.05 -0.33 0.02 0.00 -0.55 0.00 0.00 56.30 55.40 1t8p h ASN 190 Cb 0.78 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.98 1t8p h ASN 190 CO -0.09 1.09 -0.28 0.28 -1.65 0.00 0.00 177.43 176.79 1t8p h SER 191 N 0.23 -0.80 -0.15 5.81 0.02 -1.76 0.32 113.55 117.22 1t8p h SER 191 Ca -0.05 0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.89 1t8p h SER 191 Cb 1.41 0.32 -0.01 0.00 0.14 0.00 0.00 62.40 64.25 1t8p h SER 191 CO 0.14 -0.35 -0.27 0.77 -1.14 0.00 0.00 176.83 175.98 1t8p h SER 192 N -0.46 0.63 -0.07 3.07 4.64 -1.31 -2.65 113.55 117.41 1t8p h SER 192 Ca 0.05 -0.23 -0.01 0.00 -0.47 0.00 0.00 61.79 61.13 1t8p h SER 192 Cb 0.51 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1t8p h SER 192 CO -0.20 0.88 0.02 -0.09 -0.87 0.00 0.00 176.83 176.57 1t8p h ARG 193 N 0.54 0.10 -0.98 4.77 2.43 -0.93 -2.16 114.38 118.15 1t8p h ARG 193 Ca 0.07 -0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1t8p h ARG 193 Cb 0.74 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.22 1t8p h ARG 193 CO 0.06 0.28 0.64 0.00 -1.51 0.00 0.00 179.97 179.44 1t8p h ALA 194 N 0.82 1.36 -0.10 2.80 0.00 -0.28 -2.07 119.26 121.78 1t8p h ALA 194 Ca 0.02 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1t8p h ALA 194 Cb 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1t8p h ALA 194 CO -0.00 0.55 -0.51 1.25 0.00 0.00 0.00 179.25 180.54 1t8p h LEU 195 N 1.25 0.31 -0.42 0.00 7.12 -1.37 -2.92 115.31 119.28 1t8p h LEU 195 Ca 0.39 -0.16 -0.16 0.00 0.13 0.00 0.00 57.88 58.08 1t8p h LEU 195 Cb -0.01 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.02 1t8p h LEU 195 CO -0.12 0.77 -0.38 -0.07 -0.13 0.00 0.00 178.44 178.52 1t8p h LEU 196 N 0.22 0.99 -0.09 2.25 3.38 -0.89 -1.89 115.31 119.28 1t8p h LEU 196 Ca 0.01 -0.45 0.04 0.00 0.09 0.00 0.00 57.88 57.57 1t8p h LEU 196 Cb 0.98 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 1t8p h LEU 196 CO 0.08 1.24 -0.15 0.50 0.09 0.00 0.00 178.44 180.21 1t8p h LYS 197 N 0.76 -0.19 -0.08 1.13 3.64 -1.31 0.11 116.57 120.62 1t8p h LYS 197 Ca 0.06 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1t8p h LYS 197 Cb 0.97 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1t8p h LYS 197 CO 0.09 -0.13 0.05 1.25 -2.27 0.00 0.00 179.45 178.44 1t8p h HIS 198 N -0.20 0.10 -0.00 1.91 2.76 -1.43 0.13 115.15 118.42 1t8p h HIS 198 Ca 0.08 -0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.12 1t8p h HIS 198 Cb 0.32 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.22 1t8p h HIS 198 CO -0.25 0.11 -0.60 -0.07 -1.30 0.00 0.00 177.93 175.82 1t8p h LEU 199 N 0.07 0.00 -1.53 0.26 3.38 -1.19 -3.19 115.31 113.11 1t8p h LEU 199 Ca 0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1t8p h LEU 199 Cb 0.04 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1t8p h LEU 199 CO -0.01 0.61 -0.19 -0.62 0.09 0.00 0.00 178.44 178.32 1t8p n GLU 200 N -3.82 1.86 -3.52 1.13 1.02 0.37 -0.75 120.64 116.93 1t8p n GLU 200 Ca -0.01 -1.53 -0.20 0.00 -0.02 0.00 0.00 57.16 55.40 1t8p n GLU 200 Cb 0.60 -1.47 0.08 0.00 -0.02 0.00 0.00 31.44 30.63 1t8p n GLU 200 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1t8p n GLY 201 N 1.37 -0.40 3.79 0.62 0.00 0.36 -4.96 105.19 105.97 1t8p n GLY 201 Ca 0.12 0.15 -0.38 0.00 0.00 0.00 0.00 46.02 45.90 1t8p n GLY 201 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t8p s ILE 202 N -3.38 4.50 0.88 -0.61 1.01 -0.59 -5.04 121.20 117.96 1t8p s ILE 202 Ca 0.17 1.49 -0.11 0.00 0.00 0.00 0.00 60.65 62.20 1t8p s ILE 202 Cb -0.08 -4.02 0.12 0.00 0.01 0.00 0.00 42.46 38.50 1t8p s ILE 202 CO 0.74 0.46 1.09 -0.94 0.00 0.00 0.00 174.94 176.29 1t8p s SER 203 N -1.26 3.57 0.51 3.58 1.04 -1.26 -4.81 113.70 115.08 1t8p s SER 203 Ca 0.36 1.58 0.24 0.00 0.48 0.00 0.00 55.95 58.61 1t8p s SER 203 Cb -0.21 -2.26 1.39 0.00 0.10 0.00 0.00 66.02 65.04 1t8p s SER 203 CO 0.23 -2.59 2.08 0.44 0.98 0.00 0.00 173.24 174.39 1t8p h ASP 204 N -1.52 0.00 0.33 7.02 5.19 -2.01 -1.88 116.42 123.56 1t8p h ASP 204 Ca -0.48 0.00 -0.33 0.00 -0.62 0.00 0.00 57.03 55.60 1t8p h ASP 204 Cb 1.27 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.80 1t8p h ASP 204 CO 0.53 0.12 -1.52 -0.33 -3.12 0.00 0.00 179.24 174.91 1t8p h GLU 205 N 0.00 0.42 0.00 3.56 3.07 -2.02 -3.37 114.58 116.24 1t8p h GLU 205 Ca -0.00 -0.72 -0.19 0.00 -0.50 0.00 0.00 59.36 57.94 1t8p h GLU 205 Cb 0.27 0.27 -0.03 0.00 -0.84 0.00 0.00 28.75 28.42 1t8p h GLU 205 CO 0.01 1.33 -1.00 -0.44 -1.40 0.00 0.00 179.01 177.52 1t8p h ASP 206 N 0.12 0.00 -0.85 1.42 3.45 -1.88 -3.34 116.42 115.34 1t8p h ASP 206 Ca -0.26 0.00 0.22 0.00 0.43 0.00 0.00 57.03 57.42 1t8p h ASP 206 Cb 2.10 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 40.83 1t8p h ASP 206 CO 0.23 0.86 0.59 -0.29 -1.57 0.00 0.00 179.24 179.06 1t8p h ILE 207 N 0.00 0.62 -0.28 0.35 6.09 -1.51 -1.23 117.51 121.56 1t8p h ILE 207 Ca -0.05 -0.06 -0.09 0.00 -1.37 0.00 0.00 64.86 63.30 1t8p h ILE 207 Cb 1.70 0.45 -0.01 0.00 0.47 0.00 0.00 36.82 39.42 1t8p h ILE 207 CO 0.10 0.03 -0.19 0.40 -3.07 0.00 0.00 178.15 175.42 1t8p h ILE 208 N 0.16 1.25 -0.01 2.19 1.08 -1.78 -3.21 117.51 117.18 1t8p h ILE 208 Ca 0.42 -1.16 0.00 0.00 -0.39 0.00 0.00 64.86 63.73 1t8p h ILE 208 Cb 1.41 1.25 0.00 0.00 -3.07 0.00 0.00 36.82 36.41 1t8p h ILE 208 CO -0.07 0.37 -0.07 0.59 -0.69 0.00 0.00 178.15 178.28 1t8p n ASN 209 N -4.16 1.48 -4.74 1.72 3.02 -0.47 -4.95 115.26 107.17 1t8p n ASN 209 Ca 0.00 -1.38 -0.42 0.00 -0.03 0.00 0.00 54.58 52.76 1t8p n ASN 209 Cb 0.37 0.04 -0.02 0.00 -0.61 0.00 0.00 39.78 39.56 1t8p n ASN 209 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1t8p s ILE 210 N -2.13 2.40 0.03 2.41 -1.09 -1.20 -4.98 121.20 116.63 1t8p s ILE 210 Ca 0.34 0.32 -0.26 0.00 -2.23 0.00 0.00 60.65 58.82 1t8p s ILE 210 Cb 0.20 -3.21 -0.05 0.00 -1.58 0.00 0.00 42.46 37.83 1t8p s ILE 210 CO 0.38 0.04 0.83 -0.89 -1.23 0.00 0.00 174.94 174.07 1t8p s THR 211 N 0.31 4.77 -0.45 2.92 2.01 -1.26 -5.03 115.64 118.92 1t8p s THR 211 Ca 0.64 1.75 0.03 0.00 0.31 0.00 0.00 61.69 64.42 1t8p s THR 211 Cb -0.45 -4.17 0.16 0.00 0.01 0.00 0.00 72.50 68.04 1t8p s THR 211 CO 0.42 0.30 0.31 -0.76 -0.69 0.00 0.00 174.62 174.20 1t8p s LEU 212 N 0.30 2.12 0.52 4.42 1.43 -1.26 -5.12 118.68 121.08 1t8p s LEU 212 Ca 0.42 -2.90 -0.21 0.00 -1.03 0.00 0.00 54.13 50.41 1t8p s LEU 212 Cb -0.21 -0.74 -0.06 0.00 0.03 0.00 0.00 46.19 45.21 1t8p s LEU 212 CO 0.24 -0.21 1.20 -2.16 0.23 0.00 0.00 176.35 175.66 1t8p s PRO 213 N 0.11 3.42 0.51 1.29 0.04 -1.26 -4.89 135.00 134.22 1t8p s PRO 213 Ca 0.25 1.85 -0.01 0.00 0.04 0.00 0.00 61.00 63.13 1t8p s PRO 213 Cb -0.09 -2.22 0.01 0.00 0.04 0.00 0.00 34.50 32.24 1t8p s PRO 213 CO -0.10 -0.85 0.76 0.95 0.04 0.00 0.00 177.00 177.80 1t8p s THR 214 N -1.54 3.55 -0.64 1.26 -4.23 -1.26 -4.23 115.64 108.54 1t8p s THR 214 Ca 0.69 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1t8p s THR 214 Cb -0.30 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 70.19 1t8p s THR 214 CO 0.36 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.77 1t8p n GLY 215 N -2.29 0.58 3.39 3.99 0.00 -0.62 -4.95 105.19 105.29 1t8p n GLY 215 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1t8p n GLY 215 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t8p s VAL 216 N -1.44 2.91 0.01 1.61 1.01 -1.26 -4.49 120.40 118.74 1t8p s VAL 216 Ca 0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 60.94 1t8p s VAL 216 Cb 0.00 -2.17 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 1t8p s VAL 216 CO 0.00 0.55 1.34 -2.84 0.00 0.00 0.00 175.10 174.15 1t8p s PRO 217 N -0.05 4.32 -0.41 2.72 0.02 -1.26 -4.53 135.00 135.80 1t8p s PRO 217 Ca -0.03 1.90 -0.06 0.00 0.02 0.00 0.00 61.00 62.82 1t8p s PRO 217 Cb -0.14 -3.51 0.09 0.00 0.02 0.00 0.00 34.50 30.96 1t8p s PRO 217 CO 0.04 -0.50 0.23 0.42 -0.33 0.00 0.00 177.00 176.85 1t8p s ILE 218 N 2.09 3.78 0.08 2.83 1.01 0.17 -1.07 121.20 130.08 1t8p s ILE 218 Ca 0.62 -1.68 -0.30 0.00 0.00 0.00 0.00 60.65 59.29 1t8p s ILE 218 Cb -0.30 -3.42 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 1t8p s ILE 218 CO 0.26 -0.57 0.95 -0.22 0.00 0.00 0.00 174.94 175.36 1t8p s LEU 219 N 1.30 4.47 -0.10 2.97 2.96 0.25 -1.76 118.68 128.78 1t8p s LEU 219 Ca 0.04 1.74 0.01 0.00 -0.22 0.00 0.00 54.13 55.70 1t8p s LEU 219 Cb -0.23 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 42.92 1t8p s LEU 219 CO -0.01 -0.10 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.59 1t8p s LEU 220 N 0.21 1.47 -0.31 -0.68 2.96 -0.22 -1.40 118.68 120.70 1t8p s LEU 220 Ca 0.47 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.95 1t8p s LEU 220 Cb -0.23 -0.89 -0.01 0.00 0.50 0.00 0.00 46.19 45.56 1t8p s LEU 220 CO 0.29 -0.04 0.17 -1.61 -1.32 0.00 0.00 176.35 173.84 1t8p s GLU 221 N 1.19 3.39 0.04 1.98 2.02 -1.26 -1.19 118.70 124.87 1t8p s GLU 221 Ca -0.04 -0.69 0.03 0.00 0.02 0.00 0.00 54.97 54.29 1t8p s GLU 221 Cb -0.14 -3.61 -0.04 0.00 0.10 0.00 0.00 34.13 30.44 1t8p s GLU 221 CO -0.03 -0.41 -0.01 -0.51 0.02 0.00 0.00 175.26 174.32 1t8p s LEU 222 N 1.64 3.45 0.00 1.80 1.43 0.16 -0.15 118.68 127.01 1t8p s LEU 222 Ca 0.05 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.05 1t8p s LEU 222 Cb -0.17 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1t8p s LEU 222 CO 0.07 0.23 0.00 -0.90 0.23 0.00 0.00 176.35 175.98 1t8p n ASP 223 N 1.04 0.00 0.29 2.29 5.68 -0.84 -1.22 116.55 123.79 1t8p n ASP 223 Ca -0.13 -0.73 0.16 0.00 -0.50 0.00 0.00 54.79 53.59 1t8p n ASP 223 Cb 0.52 0.00 0.93 0.00 -1.14 0.00 0.00 41.12 41.43 1t8p n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1t8p h GLU 224 N 0.00 0.00 -0.65 0.11 3.07 -1.97 -0.20 114.58 114.94 1t8p h GLU 224 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1t8p h GLU 224 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1t8p h GLU 224 CO 0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 1t8p n ASN 225 N -3.80 3.58 -2.58 1.42 3.02 -1.26 -4.93 115.26 110.70 1t8p n ASN 225 Ca -0.03 -2.00 -0.19 0.00 -0.03 0.00 0.00 54.58 52.33 1t8p n ASN 225 Cb 0.10 -0.43 0.03 0.00 -0.61 0.00 0.00 39.78 38.87 1t8p n ASN 225 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1t8p n LEU 226 N 1.46 -2.45 -4.56 3.41 4.77 -0.09 -5.00 117.00 114.55 1t8p n LEU 226 Ca 0.22 -0.22 -0.34 0.00 -0.03 0.00 0.00 56.01 55.65 1t8p n LEU 226 Cb 0.57 -2.68 -0.11 0.00 -2.33 0.00 0.00 43.42 38.87 1t8p n LEU 226 CO 0.15 0.14 -0.33 -0.13 -1.33 0.00 0.00 177.39 175.90 1t8p s ARG 227 N -5.46 3.53 0.09 3.23 1.81 -1.26 -4.82 118.95 116.07 1t8p s ARG 227 Ca 0.22 -0.47 -0.34 0.00 -1.72 0.00 0.00 55.73 53.43 1t8p s ARG 227 Cb -0.10 -2.92 -0.13 0.00 -0.45 0.00 0.00 34.95 31.35 1t8p s ARG 227 CO 0.28 0.37 1.66 0.00 -0.68 0.00 0.00 175.30 176.93 1t8p n ALA 228 N 3.17 1.17 -2.60 2.13 0.00 0.07 -2.00 120.51 122.45 1t8p n ALA 228 Ca -0.18 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.23 1t8p n ALA 228 Cb 0.53 -2.39 -0.07 0.00 0.00 0.00 0.00 19.45 17.52 1t8p n ALA 228 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1t8p s VAL 229 N 1.83 4.85 0.00 0.00 1.01 0.79 -4.91 120.40 123.98 1t8p s VAL 229 Ca 0.83 -0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.67 1t8p s VAL 229 Cb -0.69 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 31.46 1t8p s VAL 229 CO 0.42 -0.67 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1t8p n GLY 230 N 5.09 -1.91 3.84 4.51 0.00 -1.26 -4.67 105.19 110.80 1t8p n GLY 230 Ca -0.04 -1.42 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 1t8p n GLY 230 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1t8p s PRO 231 N 0.00 4.04 0.65 1.61 0.04 -1.26 -5.00 135.00 135.08 1t8p s PRO 231 Ca 0.00 0.67 -0.17 0.00 0.04 0.00 0.00 61.00 61.54 1t8p s PRO 231 Cb 0.00 -2.60 -0.01 0.00 0.04 0.00 0.00 34.50 31.94 1t8p s PRO 231 CO 0.00 0.25 1.21 -3.38 0.04 0.00 0.00 177.00 175.12 1t8p s HIS 232 N -1.82 2.28 -0.03 0.56 -3.43 -1.26 -4.90 115.29 106.69 1t8p s HIS 232 Ca 0.50 1.54 0.07 0.00 -0.80 0.00 0.00 55.06 56.36 1t8p s HIS 232 Cb -0.12 -3.47 -0.01 0.00 -1.43 0.00 0.00 32.58 27.54 1t8p s HIS 232 CO 0.19 -2.35 -0.24 -0.65 -2.00 0.00 0.00 174.74 169.69 1t8p s GLN 233 N -3.58 2.09 -0.04 -0.38 -0.21 -0.49 -4.97 119.66 112.08 1t8p s GLN 233 Ca 0.76 -0.84 -0.23 0.00 0.02 0.00 0.00 55.36 55.07 1t8p s GLN 233 Cb -0.30 -1.92 -0.04 0.00 1.00 0.00 0.00 33.01 31.75 1t8p s GLN 233 CO 0.38 0.45 0.68 -0.06 -2.12 0.00 0.00 175.29 174.62 1t8p s PHE 234 N -0.40 3.62 -0.17 0.91 2.99 -1.26 -0.58 117.98 123.10 1t8p s PHE 234 Ca 0.05 1.25 -0.09 0.00 0.00 0.00 0.00 56.93 58.14 1t8p s PHE 234 Cb -0.11 -2.75 -0.05 0.00 0.00 0.00 0.00 43.02 40.12 1t8p s PHE 234 CO 0.01 0.18 0.12 -0.51 -0.00 0.00 0.00 175.22 175.02 1t8p s LEU 235 N 0.43 4.22 0.00 -0.37 1.43 -0.23 -4.96 118.68 119.20 1t8p s LEU 235 Ca 0.36 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 1t8p s LEU 235 Cb -0.18 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1t8p s LEU 235 CO 0.18 0.26 0.00 0.61 0.23 0.00 0.00 176.35 177.63 1t8p n GLY 236 N 2.98 0.97 3.74 -3.19 0.00 -1.26 -4.12 105.19 104.30 1t8p n GLY 236 Ca -0.17 -2.10 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 1t8p n GLY 236 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1t8p s ASP 237 N -0.02 7.12 0.47 1.61 1.47 -1.26 -4.92 116.67 121.14 1t8p s ASP 237 Ca 0.00 2.23 0.25 0.00 1.18 0.00 0.00 52.55 56.22 1t8p s ASP 237 Cb 0.00 -2.61 1.29 0.00 -0.34 0.00 0.00 42.92 41.26 1t8p s ASP 237 CO 0.00 -0.33 1.83 -0.61 0.68 0.00 0.00 175.17 176.74 1t8p h GLN 238 N 4.98 0.20 0.33 2.11 5.75 -1.97 -2.00 115.11 124.51 1t8p h GLN 238 Ca -0.45 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.02 1t8p h GLN 238 Cb 1.21 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.72 1t8p h GLN 238 CO 0.73 0.14 -0.16 0.93 -2.65 0.00 0.00 178.83 177.82 1t8p h GLU 239 N 0.21 -0.43 -0.52 1.69 5.08 -1.99 -1.24 114.58 117.38 1t8p h GLU 239 Ca 0.51 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.97 1t8p h GLU 239 Cb 1.64 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.96 1t8p h GLU 239 CO -0.13 -0.16 0.35 0.00 -1.00 0.00 0.00 179.01 178.07 1t8p h ALA 240 N -0.07 1.92 0.07 3.43 0.00 -1.77 -2.41 119.26 120.42 1t8p h ALA 240 Ca -0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1t8p h ALA 240 Cb 0.47 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1t8p h ALA 240 CO 0.07 -0.01 -0.03 0.82 0.00 0.00 0.00 179.25 180.10 1t8p h ILE 241 N 0.44 1.21 0.00 0.00 2.04 -1.27 -2.35 117.51 117.57 1t8p h ILE 241 Ca 0.23 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 1t8p h ILE 241 Cb 0.33 1.91 -0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1t8p h ILE 241 CO -0.06 0.27 -0.03 1.56 0.00 0.00 0.00 178.15 179.89 1t8p h GLN 242 N -0.61 0.00 0.20 2.37 1.08 -0.98 0.15 115.11 117.31 1t8p h GLN 242 Ca -0.01 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.93 1t8p h GLN 242 Cb 0.52 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.98 1t8p h GLN 242 CO 0.02 0.03 -1.13 0.00 -0.95 0.00 0.00 178.83 176.80 1t8p h ALA 243 N 1.97 -0.13 -0.57 3.87 0.00 -1.45 -2.58 119.26 120.37 1t8p h ALA 243 Ca -0.00 -0.77 -0.08 0.00 0.00 0.00 0.00 54.91 54.06 1t8p h ALA 243 Cb 0.28 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1t8p h ALA 243 CO 0.00 0.52 0.06 0.00 0.00 0.00 0.00 179.25 179.84 1t8p h ALA 244 N 0.11 0.76 -0.48 0.00 0.00 -0.83 -1.69 119.26 117.13 1t8p h ALA 244 Ca -0.20 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1t8p h ALA 244 Cb 1.89 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.45 1t8p h ALA 244 CO 0.21 0.53 0.23 0.82 0.00 0.00 0.00 179.25 181.04 1t8p h ILE 245 N 0.85 1.19 -0.26 0.00 2.04 -0.82 -2.40 117.51 118.11 1t8p h ILE 245 Ca 0.17 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 1t8p h ILE 245 Cb 0.46 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1t8p h ILE 245 CO 0.02 0.21 0.08 0.50 0.00 0.00 0.00 178.15 178.96 1t8p h LYS 246 N 0.64 0.37 0.00 2.37 1.63 -1.31 -2.70 116.57 117.57 1t8p h LYS 246 Ca 0.17 -0.04 -0.06 0.00 -0.85 0.00 0.00 60.65 59.86 1t8p h LYS 246 Cb 0.13 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.68 1t8p h LYS 246 CO -0.02 0.33 -0.29 0.87 -3.45 0.00 0.00 179.45 176.89 1t8p h LYS 247 N 0.37 0.00 -0.54 1.90 1.57 -0.79 -3.10 116.57 115.98 1t8p h LYS 247 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1t8p h LYS 247 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1t8p h LYS 247 CO -0.01 0.29 0.00 1.33 -0.57 0.00 0.00 179.45 180.49 1t8p n VAL 248 N -3.45 2.54 -1.91 0.50 0.24 -1.02 -5.00 118.33 110.23 1t8p n VAL 248 Ca 0.00 -1.45 -0.33 0.00 -2.04 0.00 0.00 64.34 60.52 1t8p n VAL 248 Cb 0.47 -0.20 0.02 0.00 -1.47 0.00 0.00 33.84 32.66 1t8p n VAL 248 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1t8p s GLU 249 N -2.63 3.13 0.00 7.34 2.12 -1.17 -4.86 118.70 122.63 1t8p s GLU 249 Ca 0.52 1.23 0.00 0.00 0.36 0.00 0.00 54.97 57.08 1t8p s GLU 249 Cb 0.39 -2.00 0.00 0.00 0.26 0.00 0.00 34.13 32.78 1t8p s GLU 249 CO 0.16 -0.97 0.00 -0.25 -0.54 0.00 0.00 175.26 173.66